Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1204171 | 0.84 | TP53 (0.42) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| Bromide SCHEMBL986860 | 0.79 | TP53 (0.38) | TP53TDP1ALDH1A1TRPA1MAPT | |
| Hydrochloric Acid SCHEMBL987591 | 0.79 | TP53 (0.38) | TP53TDP1ALDH1A1TRPA1MAPT | |
| SCHEMBL15496943 | 0.75 | AR (0.41) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| SCHEMBL15499223 | 0.73 | SMN1; SMN2 (0.41) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| Acetic Acid SCHEMBL987502 | 0.73 | CYP2C19 (0.35) | TP53TDP1ALDH1A1PTGS2TRPA1 | |
| SCHEMBL11501560 | 0.73 | TDP1 (0.41) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| SCHEMBL10896146 | 0.72 | TP53 (0.42) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| SCHEMBL29407001 | 0.72 | ALDH1A1 (0.50) | TP53TDP1ALDH1A1PTGS1PTGS2 | |
| SCHEMBL293173 | 0.72 | ALDH1A1 (0.50) | TP53TDP1ALDH1A1PTGS1PTGS2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109401731-A | A kind of amphipathy macromolecule load nano-fluid and preparation method thereof | 中国矿业大学 | 2019-03-01 | — | — | CN | disclosed |